SCHEMBL7989935

SCHEMBL7989935

COCCCOc1ccc(-c2nc(C(=O)O)c(-c3ccc(Cl)cc3)[nH]2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.48
TP53 P04637 1/20 0.45
CHEK2 O96017 2/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
DHODH Q02127 1/20 0.43
ACHE P22303 3/20 0.43
GCGR P47871 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP1A2 P05177 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
GFER P55789 1/20 0.42
MCL1 Q07820 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
PRKAB2 O43741 1/20 0.41
PRKAG1 P54619 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7989419 0.98 MAPT (0.48) MAPTTP53CHEK2MEN1KMT2A
SCHEMBL7977691 0.94 PRKAB2 (0.46) MAPTTP53CHEK2MEN1KMT2A
SCHEMBL7991891 0.91 PRKAB2 (0.44) MAPTTP53CHEK2MEN1KMT2A
SCHEMBL7991760 0.91 PRKAB2 (0.44) MAPTTP53CHEK2MEN1KMT2A
SCHEMBL7991299 0.87 SIRT2 (0.49) MAPTTP53ACHEGCGRALDH1A1
SCHEMBL7977351 0.86 PDE3B (0.43) MAPTCHEK2MEN1KMT2ADHODH
SCHEMBL7988171 0.85 SIRT2 (0.49) MAPTTP53ACHEGCGR
SCHEMBL7988460 0.85 ACHE (0.44) MAPTCHEK2MEN1KMT2ADHODH
SCHEMBL7989696 0.83 ALOX5 (0.47) MAPTTP53CHEK2MEN1KMT2A
SCHEMBL7988060 0.82 SIRT2 (0.50) MAPTTP53ACHEGCGRALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed